| Identification | Back Directory | [Name]
spathulenol,(+)-spathulenol,espatulenol | [CAS]
6750-60-3 | [Synonyms]
Spathulel
Spathulrnol
SPATHULENOL
Espatulenol
spathulenol,(+)-spathulenol,espatulenol
(1aR,4aβ,7aα,7bβ)-Decahydro-1,1,7-trimethyl-4-methylene-1H-cycloprop[e]azulen-7α-ol
(1aR,4aR,7S,7aR,7bR)-1,1,7-Trimethyl-4-methylenedecahydro-1H-cyclopropa[e]azulen-7-ol
1H-Cycloprop[e]azulen-7-ol, decahydro-1,1,7-trimethyl-4-methylene-, (1aR,4aR,7S,7aR,7bR)-
[1ar-(1aà,4aà,7á,7aá,7bà)]-Decahydro-1,1,7-trimethyl-4-methylene-1H-cycloprop[e]azulen-7-ol
1H-Cycloprop(e)azulen-7-ol, decahydro-1,1,7-trimethyl-4-methylene-, (1aR-(1aalpha,4aalpha,7beta,7abeta,7balpha))- | [Molecular Formula]
C15H24O | [MDL Number]
MFCD17214859 | [MOL File]
6750-60-3.mol | [Molecular Weight]
220.35 |
| Questions And Answer | Back Directory | [Description]
Spathulenol is a tricyclic sesquiterpene alcohol which has a basic skeleton similar to the azulenes,it occurs in oregano among other plants. | [Appearance]
Spathulenol is a colorless to pale yellow clear liquid. | [Biological activity]
Spathulenol is isolated from psidium guineense Sw, has antioxidant, anti-inflammatory, anti-proliferative and anti-mycobacterial activities. It shows high antioxidant activity in DPPH system with IC50 of 85.60 μg/mL. | [Uses]
Eucalyptol is an organic alcohol compound, mainly used for content determination and experimental research, not for other purposes. |
| Chemical Properties | Back Directory | [Boiling point ]
284.7 °C | [density ]
1.02±0.1 g/cm3(Predicted) | [form ]
Liquid | [pka]
15.10±0.40(Predicted) | [color ]
Colorless to light yellow | [Odor]
at 100.00 %. earthy herbal fruity | [Odor Type]
earthy | [InChI]
InChI=1S/C15H24O/c1-9-5-6-11-13(14(11,2)3)12-10(9)7-8-15(12,4)16/h10-13,16H,1,5-8H2,2-4H3/t10-,11+,12+,13+,15-/m0/s1 | [InChIKey]
FRMCCTDTYSRUBE-BGPZULBFSA-N | [SMILES]
C1[C@]2([H])[C@]([H])([C@]3([H])C(C)(C)[C@]3([H])CCC2=C)[C@@](C)(O)C1 | [LogP]
4.406 (est) |
| Hazard Information | Back Directory | [Definition]
ChEBI: Spathulenol is a tricyclic sesquiterpenoid that is 4-methylidenedecahydro-1H-cyclopropa[e]azulene carrying three methyl substituents at positions 1, 1 and 7 as well as a hydroxy substituent at position 7. It has a role as a volatile oil component, a plant metabolite, an anaesthetic and a vasodilator agent. It is a sesquiterpenoid, a carbotricyclic compound, a tertiary alcohol and an olefinic compound. | [in vivo]
Spathulenol (oral administration; 300 mg/kg) shows a significant inhibition in the Cg-induced mice paw oedema and pleurisy model[1].
In a spontaneous lipoperoxidation rat brain homogenate model, when incubated in controlled temperature and
oxygenation conditions, PG-1 exhibits a high activity with an IC50 value of 26.13 μg/mL, respectively, which is
comparable to a commercial antioxidant BHT (38.41 μg/mL), Thus, PG-1 contributes to a decrease in the generation of MDA,
which is a toxic product resulting from the degradation of the cell membrane by lipid peroxidation, causing cell ruptures and mutations[1]. | [References]
[1] Nascimento KF, et al. Antioxidant, anti-inflammatory, antiproliferative and antimycobacterial activities of the essential oil of Psidium guineense Sw. and spathulenol.J Ethnopharmacol. 2018 Jan 10;210:351-358. DOI:10.1016/j.jep.2017.08.030 |
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BioBioPha Co., Ltd. Gold
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0871-65217109 |
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http://www.biobiopha.com |
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